ChemicalBook--->CAS DataBase List--->91510-62-2

91510-62-2

91510-62-2 Structure

91510-62-2 Structure
IdentificationMore
[Name]

ALPHA-D-GALACTURONIC ACID HYDRATE
[CAS]

91510-62-2
[Synonyms]

ALPHA-D-GALACTURONIC ACID HYDRATE
D(+)-GALACTURONIC ACID MONOHYDRATE
D-GALACTURONIC ACID MONOHYDRATE
GALACTURONIC ACID MONOHYDRATE, D-(+)-
[EINECS(EC#)]

211-682-6
[Molecular Formula]

C6H12O8
[MDL Number]

MFCD00071585
[Molecular Weight]

212.15
[MOL File]

91510-62-2.mol
Chemical PropertiesBack Directory
[Appearance]

white to light beige fine powder
[Melting point ]

156-159℃
[alpha ]

+51.7°(23℃/D, c=1, H2O)
[refractive index ]

52.5 ° (C=10, H2O)
[storage temp. ]

Inert atmosphere,Room Temperature
[solubility ]

DMSO (Slightly, Sonicated), Methanol (Slightly), Water (Slightly)
[form ]

Powder
[color ]

White to Off-white
[Optical Rotation]

[α]20/D +53±2°, 5 hr, c = 10% in H2O
[Water Solubility ]

Soluble in water
[Merck ]

4337
[BRN ]

1727087
[InChI]

InChI=1/C6H10O7.H2O/c7-1-2(8)4(5(10)11)13-6(12)3(1)9;/h1-4,6-9,12H,(H,10,11);1H2/t1-,2+,3+,4-,6?;/s3
[InChIKey]

BGHPCEJXDOGRGW-LOIFHAGZNA-N
[SMILES]

[C@H]1(C(=O)O)OC([C@H](O)[C@@H](O)[C@H]1O)O.O |&1:0,6,8,10,r|
[CAS DataBase Reference]

91510-62-2(CAS DataBase Reference)
Safety DataBack Directory
[Safety Statements ]

24/25
[WGK Germany ]

3
[TSCA ]

Yes
[HS Code ]

29329990
Hazard InformationBack Directory
[Chemical Properties]

white to light beige fine powder
[Uses]

ALPHA-D-GALACTURONIC ACID HYDRATE is highly purified product form Pectine.It is used in the synthesis of N-(D-galacturonoyl) amino acids and dipeptides.
[Uses]

D-(+)-Galacturonic acid monohydrate is a chemical used in the synthesis of N-(D-galacturonoyl) amino acids and dipeptides.
[Uses]

Highly purified product form Pectine.
[storage]

Store at RT
[Purification Methods]

Crystallisation of the acid from 95% EtOH and drying it in a vacuum desiccator (12mm) over P2O5 gives the monohydrate mixture of and anomers (mostly -) as white micro needles, which sinter at ~100-111o and melt at 159-160o, [] D 20 +107o (initial, c 4 in H2O mutarotating to +51o). [Link & Sell Biochemical Preparations 3 74, 78 1953, Beilstein 3 IV 2000.] The -anomer is obtained by warming the -anomer in EtOH, AcOH or EtOAc and has m 1 6 0o (165o, sinters at 1 4 0o), [] D 20 +27o (initial, c 2 in H2O mutarotating to +55.3o in 24hours). The sodium salt [14984-39-5] M 216.1 has [] D 20 +27o (c 10 in H2O after 5hours). The phenylhydrazone has m 141o(from MeOH). [Ehrlich & Schubert Chem Ber 62 1974, 2014 1929, Anderson & King J Chem Soc 5333 1961, Beilstein 3 IV 2001.]
Spectrum DetailBack Directory
[Spectrum Detail]

ALPHA-D-GALACTURONIC ACID HYDRATE(91510-62-2)1HNMR
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

91510-62-2(sigmaaldrich)
[TCI AMERICA]

alpha-D-Galacturonic Acid  Hydrate,>95.0%(T)(91510-62-2)
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